1-[4-(3-methylbutoxy)phenyl]-3-piperidin-1-ium-1-yl-propan-1-one chloride

Systemtic Name: 1-[4-(3-methylbutoxy)phenyl]-3-piperidin-1-ium-1-yl-propan-1-one chloride Openeye Name: 1-(4-isopentyloxyphenyl)-3-piperidin-1-ium-1-yl-propan-1-one chloride CAS Name: 1-[4-(3-methylbutoxy)phenyl]-3-(1-piperidin-1-iumyl)-1-propanone chloride IUPAC Name: 1-[4-(3-methylbutoxy)phenyl]-3-piperidin-1-ium-1-ylpropan-1-one chloride Traditional Name: 1-(4-isoamoxyphenyl)-3-piperidin-1-ium-1-yl-propan-1-one chloride Formula: C19H30ClNO2 MolecularWeight: 339.9

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)CC[NH+]2CCCCC2.[Cl-]

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)CC[NH+]2CCCCC2.[Cl-]

InChI

InChI=1S/C19H29NO2.ClH/c1-16(2)11-15-22-18-8-6-17(7-9-18)19(21)10-14-20-12-4-3-5-13-20;/h6-9,16H,3-5,10-15H2,1-2H3;1H